N,N-diethyl-1-[[4-(quinolin-8-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methyl]piperidine-3-carboxamide

Systemtic Name: N,N-diethyl-1-[[4-(quinolin-8-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methyl]piperidine-3-carboxamide Openeye Name: N,N-diethyl-1-[[4-(8-quinolylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methyl]piperidine-3-carboxamide CAS Name: N,N-diethyl-1-[[4-(8-quinolinylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methyl]-3-piperidinecarboxamide IUPAC Name: N,N-diethyl-1-[[4-(quinolin-8-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methyl]piperidine-3-carboxamide Traditional Name: N,N-diethyl-1-[[4-(8-quinolylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methyl]nipecotamide Formula: C30H38N4O2 MolecularWeight: 486.64832

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1CCCN(C1)CC2=CC3=C(C=C2)OCCN(C3)CC4=CC=CC5=C4N=CC=C5

Isomeric SMILES

CCN(CC)C(=O)C1CCCN(C1)CC2=CC3=C(C=C2)OCCN(C3)CC4=CC=CC5=C4N=CC=C5

InChI

InChI=1S/C30H38N4O2/c1-3-34(4-2)30(35)26-11-7-15-32(21-26)19-23-12-13-28-27(18-23)22-33(16-17-36-28)20-25-9-5-8-24-10-6-14-31-29(24)25/h5-6,8-10,12-14,18,26H,3-4,7,11,15-17,19-22H2,1-2H3